(4R)-2-(4-nitrophenyl)-5-phenyl-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one

Systemtic Name: (4R)-2-(4-nitrophenyl)-5-phenyl-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one Openeye Name: (4R)-2-(4-nitrophenyl)-5-phenyl-4-(3-pyridylmethyliminomethyl)-4H-pyrazol-3-one CAS Name: (4R)-2-(4-nitrophenyl)-5-phenyl-4-(3-pyridinylmethyliminomethyl)-4H-pyrazol-3-one IUPAC Name: (4R)-2-(4-nitrophenyl)-5-phenyl-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one Traditional Name: (4R)-2-(4-nitrophenyl)-5-phenyl-4-(3-pyridylmethyliminomethyl)-2-pyrazolin-3-one Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2C=NCC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)[C@@H]2C=NCC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O3/c28-22-20(15-24-14-16-5-4-12-23-13-16)21(17-6-2-1-3-7-17)25-26(22)18-8-10-19(11-9-18)27(29)30/h1-13,15,20H,14H2/t20-/m1/s1